Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
2.2416 -0.5910 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5146 0.6770 -0.1115 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1411 0.6215 0.1425 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7388 -0.2803 -0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2884 -1.1262 -1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1819 -0.2638 -0.0966 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6898 0.6027 0.7468 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2420 -1.4267 -0.8469 Cl 0 0 0 0 0 0 0 0 0 0 0 0
3.3341 -0.3874 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8978 -1.3805 -0.4534 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1039 -0.8415 1.3066 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9311 1.4792 0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7744 0.9901 -1.1407 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0644 1.3317 1.2257 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7333 0.5951 0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers